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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:00:47 UTC
Update Date2025-03-21 18:06:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00064023
Frequency48.1
Structure
Chemical FormulaC15H20N2O2
Molecular Mass260.1525
SMILESO=C(Cc1ccccc1)NCCCN1CCCC1=O
InChI KeyFWIDOHSLTJGECO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • secondary carboxylic acid amides
  • tertiary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • phenylacetamide
  • organoheterocyclic compound
  • organooxygen compound